SCHEMBL2651609

SCHEMBL2651609

CNCc1ccc(C(=O)NCc2noc(=O)[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 11/20 0.44
▸ HDAC6 Q9UBN7 3/20 0.44
▸ HDAC1 Q13547 2/20 0.44
▸ EPHX2 P34913 5/20 0.43
▸ NR1H4 Q96RI1 3/20 0.43
▸ HDAC3 O15379 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2655940 0.88 PLA2G2A (0.42) PLA2G2AHDAC6HDAC1EPHX2NR1H4
SCHEMBL2644845 0.82 CA1 (0.53) HDAC6EPHX2NR1H4HDAC3HDAC8
Hydrochloric Acid SCHEMBL2644250 0.81 CA1 (0.52) HDAC6EPHX2NR1H4HDAC3HDAC8
SCHEMBL2652198 0.79 LSS (0.38) PLA2G2AHDAC6HDAC1EPHX2NR1H4
SCHEMBL2651344 0.77 LSS (0.39) PLA2G2AHDAC6HDAC1EPHX2NR1H4
SCHEMBL2655938 0.76 HDAC1 (0.46) PLA2G2AHDAC6HDAC1EPHX2NR1H4
SCHEMBL2651773 0.73 EPHX2 (0.41) HDAC6EPHX2NR1H4HDAC3HDAC8
SCHEMBL12373076 0.71 HDAC6 (0.54) HDAC6HDAC1EPHX2NR1H4HDAC3
SCHEMBL15896355 0.71 ALDH1A1 (0.56) PLA2G2A
SCHEMBL26167954 0.69 HDAC6 (0.56) HDAC6HDAC1EPHX2NR1H4HDAC3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030203946-A1 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2003-10-30 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030203946-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR PLA2G2A 1428/4885HDAC6 3661/4885HDAC1 2196/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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